SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '5gtk'

List of Similar Pattern of Amino Acids

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click on the DrReposER ID to view details on interfaces and similar patterns of amino acids)
(Click on the view link on the last column to view superposed patterns of amino acids)
Filter list by:
DrReposER ID / Desc. Hit
PDBID		 Hit
Macromolecule		 Res.
Matches		 Interface HETATM RMSD Dali
Z-score		 Seq.
Identity (%)		 View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1PNL_B_PACB559_0
(PENICILLIN
AMIDOHYDROLASE)		 5gtk BETAINE-ALDEHYDE
DEHYDROGENASE
(Bacillus
cereus) 		4 / 8 MET A 323
ALA A 288
ILE A 285
ASN A 273
 None
 1.15A 1pnlA-5gtkA:
undetectable
1pnlB-5gtkA:
undetectable		 1pnlA-5gtkA:
18.40
1pnlB-5gtkA:
20.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1T7I_A_017A200_2
(POL POLYPROTEIN)		 5gtk BETAINE-ALDEHYDE
DEHYDROGENASE
(Bacillus
cereus) 		4 / 7 ALA A 193
GLY A 228
ILE A 231
THR A 243
 NAD  A 501 (-4.0A)
NAD  A 501 (-3.5A)
None
NAD  A 501 (-4.7A)
 0.83A 1t7iB-5gtkA:
undetectable		 1t7iB-5gtkA:
11.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1T7J_A_478A200_2
(POL POLYPROTEIN)		 5gtk BETAINE-ALDEHYDE
DEHYDROGENASE
(Bacillus
cereus) 		4 / 7 ALA A 193
GLY A 228
ILE A 231
THR A 243
 NAD  A 501 (-4.0A)
NAD  A 501 (-3.5A)
None
NAD  A 501 (-4.7A)
 0.80A 1t7jB-5gtkA:
undetectable		 1t7jB-5gtkA:
11.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1VPO_H_TESH1010_1
(ANTI-TESTOSTERONE
(HEAVY CHAIN)
ANTI-TESTOSTERONE
(LIGHT CHAIN))		 5gtk BETAINE-ALDEHYDE
DEHYDROGENASE
(Bacillus
cereus) 		5 / 12 SER A 271
ALA A 446
GLY A 447
LEU A 425
PHE A 463
 None
 1.30A 1vpoH-5gtkA:
undetectable
1vpoL-5gtkA:
undetectable		 1vpoH-5gtkA:
17.80
1vpoL-5gtkA:
19.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2BM9_C_SAMC301_0
(CEPHALOSPORIN
HYDROXYLASE CMCI)		 5gtk BETAINE-ALDEHYDE
DEHYDROGENASE
(Bacillus
cereus) 		5 / 12 LEU A 320
GLY A 287
ASN A 286
ALA A 284
ALA A 279
 None
 0.98A 2bm9C-5gtkA:
3.4		 2bm9C-5gtkA:
18.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2J2P_C_SC2C1289_1
(FICOLIN-2)		 5gtk BETAINE-ALDEHYDE
DEHYDROGENASE
(Bacillus
cereus) 		4 / 6 SER A 421
SER A 469
LEU A 425
GLY A 424
 None
 0.98A 2j2pA-5gtkA:
undetectable
2j2pC-5gtkA:
undetectable		 2j2pA-5gtkA:
19.07
2j2pC-5gtkA:
19.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2J2P_F_SC2F1289_1
(FICOLIN-2)		 5gtk BETAINE-ALDEHYDE
DEHYDROGENASE
(Bacillus
cereus) 		4 / 6 SER A 421
SER A 469
LEU A 425
GLY A 424
 None
 0.98A 2j2pD-5gtkA:
undetectable
2j2pF-5gtkA:
undetectable		 2j2pD-5gtkA:
19.07
2j2pF-5gtkA:
19.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2X45_A_HSMA1161_1
(ALLERGEN ARG R 1)		 5gtk BETAINE-ALDEHYDE
DEHYDROGENASE
(Bacillus
cereus) 		4 / 5 VAL A 308
TYR A 313
VAL A 317
ASP A 318
 None
 1.29A 2x45A-5gtkA:
undetectable		 2x45A-5gtkA:
12.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2X45_C_HSMC1161_1
(ALLERGEN ARG R 1)		 5gtk BETAINE-ALDEHYDE
DEHYDROGENASE
(Bacillus
cereus) 		4 / 5 VAL A 308
TYR A 313
VAL A 317
ASP A 318
 None
 1.26A 2x45C-5gtkA:
undetectable		 2x45C-5gtkA:
12.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2XYT_D_TC9D1206_2
(SOLUBLE
ACETYLCHOLINE
RECEPTOR)		 5gtk BETAINE-ALDEHYDE
DEHYDROGENASE
(Bacillus
cereus) 		4 / 8 THR A 124
TYR A 128
ARG A  98
SER A 174
 None
 1.03A 2xytE-5gtkA:
undetectable		 2xytE-5gtkA:
19.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3KPB_D_SAMD1000_0
(UNCHARACTERIZED
PROTEIN MJ0100)		 5gtk BETAINE-ALDEHYDE
DEHYDROGENASE
(Bacillus
cereus) 		5 / 10 ILE A 252
THR A 248
VAL A 232
ILE A 231
ILE A 164
 None
NAD  A 501 (-3.2A)
None
None
NAD  A 501 (-4.3A)
 1.31A 3kpbD-5gtkA:
undetectable		 3kpbD-5gtkA:
13.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NDV_A_AICA375_1
(BETA-PEPTIDYL
AMINOPEPTIDASE)		 5gtk BETAINE-ALDEHYDE
DEHYDROGENASE
(Bacillus
cereus) 		5 / 11 GLY A 424
ARG A 417
ASN A 420
SER A 421
LEU A 444
 None
 1.31A 3ndvA-5gtkA:
undetectable
3ndvB-5gtkA:
undetectable		 3ndvA-5gtkA:
23.99
3ndvB-5gtkA:
23.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NDV_B_AICB376_1
(BETA-PEPTIDYL
AMINOPEPTIDASE)		 5gtk BETAINE-ALDEHYDE
DEHYDROGENASE
(Bacillus
cereus) 		5 / 11 LEU A 444
GLY A 424
ARG A 417
ASN A 420
SER A 421
 None
 1.32A 3ndvA-5gtkA:
undetectable
3ndvB-5gtkA:
undetectable		 3ndvA-5gtkA:
23.99
3ndvB-5gtkA:
23.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NDV_C_AICC375_1
(BETA-PEPTIDYL
AMINOPEPTIDASE)		 5gtk BETAINE-ALDEHYDE
DEHYDROGENASE
(Bacillus
cereus) 		5 / 11 GLY A 424
ARG A 417
ASN A 420
SER A 421
LEU A 444
 None
 1.32A 3ndvC-5gtkA:
undetectable
3ndvD-5gtkA:
undetectable		 3ndvC-5gtkA:
23.99
3ndvD-5gtkA:
23.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NDV_D_AICD374_1
(BETA-PEPTIDYL
AMINOPEPTIDASE)		 5gtk BETAINE-ALDEHYDE
DEHYDROGENASE
(Bacillus
cereus) 		5 / 11 LEU A 444
GLY A 424
ARG A 417
ASN A 420
SER A 421
 None
 1.31A 3ndvC-5gtkA:
undetectable
3ndvD-5gtkA:
undetectable		 3ndvC-5gtkA:
23.99
3ndvD-5gtkA:
23.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3SI7_A_ACTA5_0
(CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR)		 5gtk BETAINE-ALDEHYDE
DEHYDROGENASE
(Bacillus
cereus) 		3 / 3 LYS A 250
SER A 422
GLN A 468
 None
 1.22A 3si7A-5gtkA:
undetectable		 3si7A-5gtkA:
19.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3VLN_A_ASCA904_0
(GLUTATHIONE
S-TRANSFERASE
OMEGA-1)		 5gtk BETAINE-ALDEHYDE
DEHYDROGENASE
(Bacillus
cereus) 		4 / 6 PHE A 463
LEU A 475
PRO A 462
GLU A 474
 None
 1.41A 3vlnA-5gtkA:
undetectable		 3vlnA-5gtkA:
19.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4DV1_A_SRYA1601_1
(16S RRNA
RIBOSOMAL PROTEIN
S12)		 5gtk BETAINE-ALDEHYDE
DEHYDROGENASE
(Bacillus
cereus) 		3 / 3 LYS A  11
LYS A   9
PRO A  10
 None
 1.00A 4dv1L-5gtkA:
undetectable		 4dv1L-5gtkA:
14.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FE1_A_PQNA846_1
(PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A1
PHOTOSYSTEM I
REACTION CENTER
SUBUNIT IX)		 5gtk BETAINE-ALDEHYDE
DEHYDROGENASE
(Bacillus
cereus) 		5 / 10 SER A 421
ALA A 446
LEU A 425
GLY A 269
ALA A 180
 None
 1.45A 4fe1A-5gtkA:
2.2
4fe1J-5gtkA:
undetectable		 4fe1A-5gtkA:
19.69
4fe1J-5gtkA:
6.40
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4FR8_A_TNGA601_1
(ALDEHYDE
DEHYDROGENASE,
MITOCHONDRIAL)		 5gtk BETAINE-ALDEHYDE
DEHYDROGENASE
(Bacillus
cereus) 		6 / 11 ASN A 168
PHE A 169
MET A 173
CYH A 300
SER A 301
PHE A 463
 NAD  A 501 ( 4.1A)
None
None
NAD  A 501 (-2.8A)
None
None
 1.35A 4fr8A-5gtkA:
58.9		 4fr8A-5gtkA:
53.08
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4FR8_A_TNGA601_1
(ALDEHYDE
DEHYDROGENASE,
MITOCHONDRIAL)		 5gtk BETAINE-ALDEHYDE
DEHYDROGENASE
(Bacillus
cereus) 		6 / 11 ASN A 168
PHE A 169
TRP A 176
CYH A 300
SER A 301
PHE A 463
 NAD  A 501 ( 4.1A)
None
None
NAD  A 501 (-2.8A)
None
None
 1.49A 4fr8A-5gtkA:
58.9		 4fr8A-5gtkA:
53.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4K36_A_SAMA504_0
(ANAEROBIC
SULFATASE-MATURATING
ENZYME)		 5gtk BETAINE-ALDEHYDE
DEHYDROGENASE
(Bacillus
cereus) 		5 / 12 TYR A 483
LEU A 190
VAL A 161
ILE A 188
CYH A 186
 None
 1.14A 4k36A-5gtkA:
undetectable		 4k36A-5gtkA:
21.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4K36_B_SAMB504_0
(ANAEROBIC
SULFATASE-MATURATING
ENZYME)		 5gtk BETAINE-ALDEHYDE
DEHYDROGENASE
(Bacillus
cereus) 		5 / 12 TYR A 483
LEU A 190
VAL A 161
ILE A 188
CYH A 186
 None
 1.16A 4k36B-5gtkA:
undetectable		 4k36B-5gtkA:
21.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4OLT_B_GCSB301_1
(CHITOSANASE)		 5gtk BETAINE-ALDEHYDE
DEHYDROGENASE
(Bacillus
cereus) 		3 / 3 GLY A 340
PRO A 341
GLN A 298
 None
 0.42A 4oltB-5gtkA:
undetectable		 4oltB-5gtkA:
19.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QWP_B_GCSB305_1
(CHITOSANASE)		 5gtk BETAINE-ALDEHYDE
DEHYDROGENASE
(Bacillus
cereus) 		3 / 3 GLY A 340
PRO A 341
GLN A 298
 None
 0.33A 4qwpB-5gtkA:
undetectable		 4qwpB-5gtkA:
19.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4RZV_A_032A801_2
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 5gtk BETAINE-ALDEHYDE
DEHYDROGENASE
(Bacillus
cereus) 		4 / 5 ILE A 237
VAL A 161
PHE A 212
HIS A 235
 None
 1.39A 4rzvA-5gtkA:
undetectable		 4rzvA-5gtkA:
18.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ZBR_A_NPSA602_1
(SERUM ALBUMIN)		 5gtk BETAINE-ALDEHYDE
DEHYDROGENASE
(Bacillus
cereus) 		5 / 12 PHE A 463
TYR A 454
GLY A 464
SER A 469
SER A 304
 None
 1.41A 4zbrA-5gtkA:
undetectable		 4zbrA-5gtkA:
22.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ECK_A_ILEA601_0
(JASMONIC ACID-AMIDO
SYNTHETASE JAR1)		 5gtk BETAINE-ALDEHYDE
DEHYDROGENASE
(Bacillus
cereus) 		4 / 6 ALA A  49
THR A  39
VAL A  47
TYR A  40
 None
NA  A 502 (-3.8A)
None
None
 0.91A 5eckA-5gtkA:
undetectable		 5eckA-5gtkA:
23.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ECK_D_ILED601_0
(JASMONIC ACID-AMIDO
SYNTHETASE JAR1)		 5gtk BETAINE-ALDEHYDE
DEHYDROGENASE
(Bacillus
cereus) 		4 / 6 ALA A  49
THR A  39
VAL A  47
TYR A  40
 None
NA  A 502 (-3.8A)
None
None
 0.90A 5eckD-5gtkA:
undetectable		 5eckD-5gtkA:
23.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5FSA_A_X2NA590_1
(CYP51 VARIANT1)		 5gtk BETAINE-ALDEHYDE
DEHYDROGENASE
(Bacillus
cereus) 		5 / 12 ALA A  91
LEU A 190
ILE A  59
GLY A 222
LEU A 201
 None
 1.03A 5fsaA-5gtkA:
undetectable		 5fsaA-5gtkA:
23.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HWA_A_GCSA303_1
(CHITOSANASE)		 5gtk BETAINE-ALDEHYDE
DEHYDROGENASE
(Bacillus
cereus) 		4 / 5 HIS A 234
VAL A 220
GLY A 228
ALA A 227
 None
None
NAD  A 501 (-3.5A)
None
 0.79A 5hwaA-5gtkA:
undetectable		 5hwaA-5gtkA:
19.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5LG3_I_Z80I401_1
(GAMMA-AMINOBUTYRIC-A
CID RECEPTOR SUBUNIT
BETA-1)		 5gtk BETAINE-ALDEHYDE
DEHYDROGENASE
(Bacillus
cereus) 		4 / 9 ILE A 393
VAL A 365
THR A 382
ILE A 355
 None
 1.04A 5lg3I-5gtkA:
undetectable		 5lg3I-5gtkA:
21.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VLM_F_CVIF301_0
(REGULATORY PROTEIN
TETR)		 5gtk BETAINE-ALDEHYDE
DEHYDROGENASE
(Bacillus
cereus) 		5 / 12 MET A 339
ALA A 324
GLY A 368
GLU A 370
LEU A 329
 None
 1.48A 5vlmF-5gtkA:
undetectable		 5vlmF-5gtkA:
18.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6CI6_A_NBOA606_1
(SERUM ALBUMIN)		 5gtk BETAINE-ALDEHYDE
DEHYDROGENASE
(Bacillus
cereus) 		5 / 12 PHE A 463
TYR A 454
GLY A 464
SER A 469
SER A 304
 None
 1.36A 6ci6A-5gtkA:
undetectable		 6ci6A-5gtkA:
10.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6MB5_A_NMYA301_0
(AAC(3)-IIIB PROTEIN)		 5gtk BETAINE-ALDEHYDE
DEHYDROGENASE
(Bacillus
cereus) 		5 / 11 ASN A 273
ASP A 453
THR A 431
ASP A 280
GLU A 283
 None
 1.37A 6mb5A-5gtkA:
undetectable		 6mb5A-5gtkA:
10.05